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Ligand

NameCHEMBL2158025
Molecular formulaC29H29N3OS
IUPAC nameN-[1-[2-(2-phenylphenyl)sulfanylethyl]piperidin-4-yl]quinoline-2-carboxamide
Molecular weight467.631
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP6.2
SynonymsBDBM50393418
Inchi KeyAEOMCRCZEAWQBH-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H29N3OS/c33-29(27-15-14-23-10-4-6-12-26(23)31-27)30-24-16-18-32(19-17-24)20-21-34-28-13-7-5-11-25(28)22-8-2-1-3-9-22/h1-15,24H,16-21H2,(H,30,33)
PubChem CID71454898
ChEMBLCHEMBL2158025
IUPHARN/A
BindingDB50393418
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
36925-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479

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